SCHEMBL1047411

SCHEMBL1047411

CC(C)(C)C1CC(c2nc(CSc3ccc(S(C)(=O)=O)cc3)cs2)CCN1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 1/20 0.35
CPT1A P50416 1/20 0.35
CPT1B Q92523 1/20 0.35
PTGS2 P35354 1/20 0.34
GPR119 Q8TDV5 4/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
GCK P35557 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18727727 0.85 PTGS2 (0.38) CPT2CPT1ACPT1BPTGS2GPR119
SCHEMBL1045100 0.79 PRNP (0.37) GPR119MEN1KMT2AMAPT
SCHEMBL1047470 0.79 GPR119 (0.37) GPR119
SCHEMBL1047546 0.79 ALDH1A1 (0.52) MEN1KMT2AMAPT
SCHEMBL1118464 0.79 GPR119 (0.51) GPR119
SCHEMBL1047409 0.78 KMT2A (0.38) GPR119MEN1KMT2A
SCHEMBL1046058 0.78 GPR119 (0.35) GPR119
SCHEMBL14874966 0.78 GPR119 (0.39) CPT2CPT1ACPT1BPTGS2GPR119
SCHEMBL1046766 0.77 ALDH1A1 (0.39) MEN1KMT2AMAPT
SCHEMBL1044109 0.77 HSD11B1 (0.31) GPR119

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2272846-A1 Thiazolylpiperidine derivatives as fungicide Bayer CropScience AG (DE) 2011-01-12 EP claimed
EP-2445907-A1 THIAZOLYLPIPERIDINE DERIVATES AS FUNGICIDES Bayer Cropscience AG (DE) 2012-05-02 EP disclosed
EP-2272846-A1 Thiazolylpiperidine derivatives as fungicide Bayer CropScience AG (DE) 2011-01-12 EP disclosed
EP-2272846-A1 Thiazolylpiperidine derivatives as fungicide Bayer CropScience AG (DE) 2011-01-12 EP disclosed
WO-2010149275-A1 THIAZOLYLPIPERIDINE DERIVATES AS FUNGICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-12-29 WO disclosed